Bicyclo(4.1.0)hepta-1,3,5-triene structure

Bicyclo(4.1.0)hepta-1,3,5-triene

bicyclo[4.1.0]hepta-1,3,5-triene

Also Known As: Bicyclo[4.1.0]hepta-1,3,5-triene|1,3,5-Norcaratriene|Cyclopropabenzene|Benzocyclopropene|1,2-Methanobenzene|Bicyclo(4.1.0)hepta-1,3,5-triene|bicyclo4.1.0hepta-1,3,5-triene|bicyclo[4.1.0]hepta-1,3,5-trien|Bicyclo[4.1.0]hepta-1,3,5-triene #|BICYCLO[4.1.0]HEPTA-1(6),2,4-TRIENE|S01-0867|S14-1209

CAS: 4646-69-9
Molecular Formula C7H6
Molecular Weight 90.04695 g/mol
LogP 1.5
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
Rotatable Bonds 0
Exact Mass 90.04695
Monoisotopic Mass 90.04695
Heavy Atoms 7
Complexity 66.0

Chemical Identifiers

CAS Number 4646-69-9
SMILES C1C2=CC=CC=C21
InChIKey AMSMVCOBCOZLEE-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (1 patents) Catalysts (1 patents) Electronic Chemicals (1 patents) Heterocyclic Building Blocks (8 patents) Organic Building Blocks (1 patents) Organometallic Reagents (2 patents) Pharmaceutical Intermediates (15 patents) Polymer Intermediates (3 patents)

Product Overview

Bicyclo(4.1.0)hepta-1,3,5-triene (CAS 4646-69-9), with molecular formula C7H6 and molecular weight 90.04695 g/mol. IUPAC: bicyclo[4.1.0]hepta-1,3,5-triene.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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